SCHEMBL10072088

SCHEMBL10072088

C=C1OB(c2ccc(C(F)(F)F)cc2Cl)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.36
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10072089 0.86 NOTUM (0.32) PDE2AMAPT
SCHEMBL12565130 0.81 MEN1 (0.33)
SCHEMBL837116 0.80 PDE2A (0.41) PDE2AALDH1A1MAPT
SCHEMBL13268220 0.77 CFTR (0.45) ALDH1A1MAPT
SCHEMBL13080948 0.77 LPL (0.33)
SCHEMBL14792949 0.75 TSHR (0.34)
SCHEMBL13118388 0.73 KIF11 (0.34) ALDH1A1
SCHEMBL12920534 0.71 PTGDR2 (0.36) MAPT
SCHEMBL12565133 0.70 PPARD (0.44) ALDH1A1MAPT
SCHEMBL22366955 0.70 LIPE (0.34) PDE2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143068-B2 Oxidation resistant indicator molecules SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2012-03-27 US disclosed
US-20110081727-A1 Oxidation Resistant Indicator Molecules SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2011-04-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110081727-A1 Oxidation Resistant Indicator Molecules AOX1, GPX4, SQOR PDE2A 4157/4885ALDH1A1 129/4885MAPT 4290/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.